4-(3,5-dimethylpiperidin-1-yl)carbonyl-2-methyl-3-(1-methylindol-3-yl)-3,4-dihydroisoquinolin-1-one

Systemtic Name: 4-(3,5-dimethylpiperidin-1-yl)carbonyl-2-methyl-3-(1-methylindol-3-yl)-3,4-dihydroisoquinolin-1-one Openeye Name: 4-(3,5-dimethylpiperidine-1-carbonyl)-2-methyl-3-(1-methylindol-3-yl)-3,4-dihydroisoquinolin-1-one CAS Name: 4-[(3,5-dimethyl-1-piperidinyl)-oxomethyl]-2-methyl-3-(1-methyl-3-indolyl)-3,4-dihydroisoquinolin-1-one IUPAC Name: 4-(3,5-dimethylpiperidine-1-carbonyl)-2-methyl-3-(1-methylindol-3-yl)-3,4-dihydroisoquinolin-1-one Traditional Name: 4-(3,5-dimethylpiperidine-1-carbonyl)-2-methyl-3-(1-methylindol-3-yl)-3,4-dihydroisocarbostyril Formula: C27H31N3O2 MolecularWeight: 429.55394

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)C(=O)C2C(N(C(=O)C3=CC=CC=C23)C)C4=CN(C5=CC=CC=C54)C)C

Isomeric SMILES

CC1CC(CN(C1)C(=O)C2C(N(C(=O)C3=CC=CC=C23)C)C4=CN(C5=CC=CC=C54)C)C

InChI

InChI=1S/C27H31N3O2/c1-17-13-18(2)15-30(14-17)27(32)24-20-10-5-6-11-21(20)26(31)29(4)25(24)22-16-28(3)23-12-8-7-9-19(22)23/h5-12,16-18,24-25H,13-15H2,1-4H3